Compound Identification
SMILES
NS(=O)(=O)C1=C(F)C=C(F)C(=C1)C#CC1=C2N=C(C=C(C3CC3)N2N=C1)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=GGGLANNBBIUURD-UHFFFAOYSA-N
Formula
C24H15F5N4O2S
Mass
518.46
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Phenylpyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrimidines
Alternative Parents
Trifluoromethylbenzenes Benzenesulfonamides Pyrazolo[1,5-a]pyrimidines Benzenesulfonyl compounds Fluorobenzenes Aryl fluorides Organosulfonamides Heteroaromatic compounds Aminosulfonyl compounds Pyrazoles Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyrimidine - Benzenesulfonamide - Trifluoromethylbenzene - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Benzenesulfonyl group - Fluorobenzene - Halobenzene - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Organosulfonic acid amide - Heteroaromatic compound - Aminosulfonyl compound - Azole - Sulfonyl - Pyrazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Azacycle - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organonitrogen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available